UCSF

ZINC19906927

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 13 Yes

Popular Name: N-Butyl-1-ethylpiperidin-4-amine N-Butyl-1-ethylpiperidin-4-amine

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CAS Numbers: , 1019489-97-4

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.33 4.39 -37.63 2 2 1 20 185.335 5 ↓
Lo Low (pH 4.5-6) 2.33 6.75 -100.8 3 2 2 21 186.343 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )